1-[1-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-2-yl]propan-1-one dihydrochloride

Systemtic Name: 1-[1-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-2-yl]propan-1-one dihydrochloride Openeye Name: 1-[1-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]-2-naphthyl]propan-1-one dihydrochloride CAS Name: 1-[1-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy]-2-naphthalenyl]-1-propanone dihydrochloride IUPAC Name: 1-[1-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propoxy]naphthalen-2-yl]propan-1-one dihydrochloride Traditional Name: 1-[1-[2-hydroxy-3-(4-phenylpiperazino)propoxy]-2-naphthyl]propan-1-one dihydrochloride Formula: C26H32Cl2N2O3 MolecularWeight: 491.44988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C2=CC=CC=C2C=C1)OCC(CN3CCN(CC3)C4=CC=CC=C4)O.Cl.Cl

Isomeric SMILES

CCC(=O)C1=C(C2=CC=CC=C2C=C1)OCC(CN3CCN(CC3)C4=CC=CC=C4)O.Cl.Cl

InChI

InChI=1S/C26H30N2O3.2ClH/c1-2-25(30)24-13-12-20-8-6-7-11-23(20)26(24)31-19-22(29)18-27-14-16-28(17-15-27)21-9-4-3-5-10-21;;/h3-13,22,29H,2,14-19H2,1H3;2*1H